%chk=000080194.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080194

0 1
 O   -2.147800     -0.9003000     -0.2000000    
 O   0.9053000      -3.583800     -0.1136000    
 O   -1.251200      -3.184600     -0.2094000    
 O    3.350300       2.112100      0.1405000    
 O    4.054500      3.2900002E-02  0.1272000    
 N  -6.3699998E-02  -2.788900     -0.1419000    
 N    3.127300      0.8779000      0.1015000    
 C   -1.690500       1.898700     -0.1085000    
 C  -0.5501000      0.8676000     -7.7000000E-02
 C   -1.197600       3.197900     -0.7815000    
 C   -2.145400       2.214500       1.332900    
 C   -2.938900       1.426400     -0.8876000    
 C  -0.8545000     -0.4700000     -0.1243000    
 C   0.7364000       1.344100     -2.6000000E-03
 C   0.1931000      -1.390500     -9.5299996E-02
 C    1.784000      0.4236000      2.6699999E-02
 C    1.512300     -0.9438000     -1.9700000E-02
 C   -2.823500      -1.133800       1.032700    
 H   -2.033800       3.886500     -0.9582000    
 H  -0.4985000       3.768100     -0.1602000    
 H  -0.7335000       3.004600      -1.756100    
 H   -1.323200       2.646600       1.916400    
 H   -2.963600       2.944000       1.334300    
 H   -2.486200       1.333800       1.879400    
 H   -3.527800       2.297800      -1.206900    
 H   -2.678100      0.9006000      -1.813600    
 H   -3.662700      0.8505000     -0.3172000    
 H   0.9649000       2.398900      7.0000000E-02
 H    2.331200      -1.659100      2.9000000E-03
 H   -3.676700     -0.4663000       1.163200    
 H   -2.158900      -1.043100       1.899600    
 H   -3.227300      -2.151100       1.020700    


%chk=000080194-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000080194

0 1
O -2.277565 -0.618622 0.484077
O 0.698390 -3.564851 0.777577
O -1.200318 -3.223506 -0.443633
O 3.405397 2.035591 -0.489090
O 4.071322 -0.125141 -0.171316
N -0.162024 -2.795165 0.200672
N 3.160978 0.784700 -0.274589
C -1.722203 2.115587 -0.172876
C -0.629391 1.019627 -0.082192
C -1.116791 3.491601 -0.563167
C -2.423783 2.289028 1.210196
C -2.766755 1.736401 -1.267766
C -0.952398 -0.360655 0.198650
C 0.728905 1.346602 -0.245696
C 0.096958 -1.338707 0.198720
C 1.747338 0.371645 -0.134827
C 1.452996 -0.977388 0.079701
C -2.715986 -1.731932 1.354609
H -1.936636 4.227185 -0.644731
H -0.409222 3.871140 0.197146
H -0.602218 3.459142 -1.541259
H -1.692835 2.574169 1.989450
H -3.176587 3.095659 1.138758
H -2.935887 1.367270 1.525880
H -3.536831 2.527455 -1.328251
H -2.283761 1.655627 -2.259062
H -3.267080 0.781906 -1.044070
H 1.036581 2.374770 -0.439623
H 2.240341 -1.733798 0.120420
H -3.619192 -1.348852 1.853221
H -1.940731 -1.976538 2.103483
H -2.945211 -2.618149 0.743987


